Exact Mass: 352.1859
Exact Mass Matches: 352.1859
Found 500 metabolites which its exact mass value is equals to given mass value 352.1859
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Ajmalicine
Ajmalicine is a monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from several Rauvolfia and Catharanthus species. It is a selective alpha1-adrenoceptor antagonist used for the treatment of high blood pressure. It has a role as an antihypertensive agent, an alpha-adrenergic antagonist and a vasodilator agent. It is a monoterpenoid indole alkaloid, a methyl ester and an organic heteropentacyclic compound. It is a conjugate base of an ajmalicine(1+). Ajmalicine is a natural product found in Crossosoma bigelovii, Rauvolfia yunnanensis, and other organisms with data available. A monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from several Rauvolfia and Catharanthus species. It is a selective alpha1-adrenoceptor antagonist used for the treatment of high blood pressure. D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents INTERNAL_ID 2326; CONFIDENCE Reference Standard (Level 1) CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2326 [Raw Data] CB001_Ajmalicine_pos_40eV_CB000004.txt [Raw Data] CB001_Ajmalicine_pos_10eV_CB000004.txt [Raw Data] CB001_Ajmalicine_pos_50eV_CB000004.txt [Raw Data] CB001_Ajmalicine_pos_20eV_CB000004.txt [Raw Data] CB001_Ajmalicine_pos_30eV_CB000004.txt Ajmalicine (Raubasine) is a potent adrenolytic agent which preferentially blocks α1-adrenoceptor. Ajmalicine is an reversible but non-competitive nicotine receptor full inhibitor, with an IC50 of 72.3 μM. Ajmalicine also can be used as anti-hypertensive, and serpentine, with sedative activity[1][2]. Ajmalicine (Raubasine) is a potent adrenolytic agent which preferentially blocks α1-adrenoceptor. Ajmalicine is an reversible but non-competitive nicotine receptor full inhibitor, with an IC50 of 72.3 μM. Ajmalicine also can be used as anti-hypertensive, and serpentine, with sedative activity[1][2]. Ajmalicine (Raubasine) is a potent adrenolytic agent which preferentially blocks α1-adrenoceptor. Ajmalicine is an reversible but non-competitive nicotine receptor full inhibitor, with an IC50 of 72.3 μM. Ajmalicine also can be used as anti-hypertensive, and serpentine, with sedative activity[1][2].
Clidinium
Clidinium is a synthetic anticholinergic agent which has been shown in experimental and clinical studies to have a pronounced antispasmodic and antisecretory effect on the gastrointestinal tract. It inhibits muscarinic actions of acetylcholine at postganglionic parasympathetic neuroeffector sites. It is used for the treatment of peptic ulcer disease and also to help relieve abdominal or stomach spasms or cramps due to colicky abdominal pain, diverticulitis, and irritable bowel syndrome. C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics
Rhazin
Akuammidine is a natural product found in Aspidosperma quebracho-blanco, Tabernaemontana citrifolia, and other organisms with data available.
Vobasine
An indole alkaloid that is vobasan in which the bridgehead methyl group is substituted by a methoxycarbonyl group and an additional oxo substituent is present in the 3-position.
Lochnericine
An Aspidosperma alkaloid with molecular formula C21H24N2O3 found in the roots of Madagascar periwinkle (Catharanthus roseus, formerly known as Vinca rosea).
1,2-dihydrovomilenine
An indole alkaloid obtained by selective hydrogenation of the 1,2-position of vomilenine.
3-Allyloxyestra-1,3,5(10),7-tetraene-16,17-dione dioxime
9-Chloro-11beta-hydroxy-17-methyltestosterone
Raucaffrinoline
An indole alkaloid having a ajmalan-type skeleton and characterised by a 17alpha-acetoxy group, a 21beta-methyl group, loss of the 1-methyl group with associated unsaturation at N(1)=C(2), and a 20alpha-hydroxymethyl group in place of the 20beta-ethyl side-chain.
(3R)-3-hydroxy-1,2-didehydro-2,3-dihydrotabersonine
Tetrahydroalstonine
Annotation level-1 D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents CASMI2013 Challenge_14 MS2 data
1-(4-Amino-5-chloro-2-methoxyphenyl)-3-(1-butyl-4-piperidinyl)-1-propanone
Quebrachidine
Quebrachidine is an alkaloid from Aspidosperma quebracho-blanco (quebracho D000970 - Antineoplastic Agents > D014748 - Vinca Alkaloids
[4]-Gingerdiol 3,5-diacetate
[4]-Gingerdiol 3,5-diacetate is found in herbs and spices. [4]-Gingerdiol 3,5-diacetate is a constituent of ginger (Zingiber officinale).
(+)-Quebrachidine
(+)-Quebrachidine is an alkaloid from Aspidosperma quebracho-blanco (quebracho
(R)-3-((2-(2-(4-Methylpiperidin-1-yl)ethyl)pyrrolidin-1-yl)sulfonyl)phenol
Ajmalicine
D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
Almokalant
D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
Phenothiazine, 10-((N-butyl-2-piperidyl)methyl)-
2,3-Dimethoxy-5-methyl-6-(9'-carboxynonyl)-1,4-benzoquinone
Lamuran
Tetrahydroalstonine is a heteropentacyclic compound that is (20alpha)-16,17-didehydro-18-oxayohimban which is substituted at position 16 by a methoxycarbonyl group and at position 19 by a methyl group. It is a metabolite found in several plant species. It has a role as a plant metabolite. It is a yohimban alkaloid, an organic heteropentacyclic compound and a methyl ester. It is a conjugate base of a tetrahydroalstonine(1+). Tetrahydroalstonine is a natural product found in Ochrosia elliptica, Tabernanthe iboga, and other organisms with data available. See also: Cats Claw (part of). A heteropentacyclic compound that is (20alpha)-16,17-didehydro-18-oxayohimban which is substituted at position 16 by a methoxycarbonyl group and at position 19 by a methyl group. It is a metabolite found in several plant species. D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
Methyl 8-oxo-2,3-didehydroaspidospermidine-3-carboxylate
8-Hydroxy-9-isobutyryloxy-10(2)-methylbutyrylthymol
6,10-Bis(acetoxymethyl)-12-hydroxy-2-methyl-2,6,10-dodecatrienal
Protostrychnine
A monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from Strychnos icaja and Strychnos nux-vomica.
13beta,14-Diacetoxy-9(12)-capnellene-8beta,10alpha-diol
2beta,5alpha-Diacetoxy-9(12)-capnellene-8beta,10alpha-diol
3-[(E)-3,4-dihydroxy-3,5-dimethylhept-1-enyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one
10-oxo-2,3-didehydro-aspidospermidine-3-carboxylic acid methyl ester|Ervinidin|Ervinidinin
(1R,3E,7E,11S,12R,14S)-11-chloro-12-hydroxycembra-3,7,15(17)-trien-16,14-olide|crassocolide H
4beta,10alpha-dihydroxy-3-oxo-8beta-isobutyryloxyguaia-11(13)-en-12,6alpha-olide
1-oxoacetyl-cur-19-en-17-ol cyclic hemiacetal|11-hydroxy-12-oxa-12,23-seco-12a-homo-24-nor-strychnidin-10-one|15-ethylidene-10-hydroxy-2,3,12a,13,14,14a-hexahydro-12H,12bH-1,13-ethano-[1,4]oxazepino[4,5,6-lm]pyrrolo[2,3-d]carbazol-9-one|25-nor-tsilanine|O-Demethyltsilanin
6,7-Dehydro-8-oxokopsinin|8-oxo-aspidofractinine-3-carboxylic acid methyl ester
MEGxp0_001143
2-Methylbutyric acid 10-(isobutyryloxy)-8-hydroxythymol-9-yl ester is a natural product found in Arnica montana with data available.
(17alpha)-17-hydroxy-Delta14-kopsinine|17-alpha-hydroxy-Delta14,15-kopsinine|17-Hydroxy-Delta14,15-kopsinine|17alpha-hydroxy-Delta14,15-kopsinine
19(E)-9,18-didemethoxygardneramine
A natural product found in Gardneria ovata.
N-(4-(2-(4-hydroxyphenyl)acetamido)butyl)cinnamamide|perviridamide
(15beta,16E,17b,20a)-16-ethylidene-17-hydroxy-20-methyl-18-oxayohimban-21-one|Latifoliamide B
2,5alpha-epoxy-1-methyl-(2alpha)-1,2-dihydro-akuammilan-17-oic acid methyl ester|Ervincin|N-methyl-picrinine
16-(hydroxymethyl)pleiocarpamine|16-Hydroxymethylpleiocarpamine
Bis(isobutyric acid)2-hydroxy-2-(2-methoxy-4-methylphenyl)-1,3-propanediyl ester
tert-Butyl glycoside-alpha-Pyranose-2-O-alpha-Rhamnopyranosyl-L-arabinose
Des-N-(methoxycarbonyl)chanofruticosin-methylester
(4beta,10E)-6alpha,14,15-trihydroxy-8beta-(isobutyryloxy)germacra-10,11,(13)-diene-12-oic acid 12,6-lactone|14,15-dihydroxy-8beta-isobutyryloxygermacra-1(10)E,11(13)-dien-12,6alpha-olide
8beta,10beta-dihydroxy-6beta-isobutyryloxyeremophil-7(11)-en-(12,8)-olide
(15alpha,16R,19E)-10-methoxy-17,22-epoxyvobasan-3-one|10-methoxy-16-de(methoxycarbonyl)pagicerine
2-(7-hydroxy-1-oxooctyl)-3-hydroxy-5-methoxybenzeneacetic acid ethyl ester
2-isoprenyl-5-isopropylphenyl 4-O-beta-D-xylopyranoside
17-acetoxy-21-methyl-18-nor-sarpagan-19-al|O-Acetyl-preperakin
1beta-hydroperoxy-3beta-hydroxy-8alpha-isobutyryloxygermacra-4E,10(14),11(13)-trien-12,6alpha-olide
(Z)-Akuammidine
1ST169511
3-[(E)-3,4-dihydroxy-3,5-dimethylhept-1-enyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one
C21H24N2O3_(1S,8R,16S,17R)-11,12-Dimethoxy-5,15-diazahexacyclo[13.4.2.0~1,16~.0~5,16~.0~8,17~.0~9,14~]henicosa-2,9,11,13-tetraen-21-one
(1S,8R,16S,17R)-11,12-dimethoxy-5,15-diazahexacyclo[13.4.2.0¹,¹⁶.0⁵,¹⁶.0⁸,¹⁷.0⁹,¹⁴]henicosa-2,9,11,13-tetraen-21-one
akuammigine
A monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from Vinca sardoa and Uncaria rhynchophylla. D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
raubasine
Ajmalicine (Raubasine) is a potent adrenolytic agent which preferentially blocks α1-adrenoceptor. Ajmalicine is an reversible but non-competitive nicotine receptor full inhibitor, with an IC50 of 72.3 μM. Ajmalicine also can be used as anti-hypertensive, and serpentine, with sedative activity[1][2]. Ajmalicine (Raubasine) is a potent adrenolytic agent which preferentially blocks α1-adrenoceptor. Ajmalicine is an reversible but non-competitive nicotine receptor full inhibitor, with an IC50 of 72.3 μM. Ajmalicine also can be used as anti-hypertensive, and serpentine, with sedative activity[1][2]. Ajmalicine (Raubasine) is a potent adrenolytic agent which preferentially blocks α1-adrenoceptor. Ajmalicine is an reversible but non-competitive nicotine receptor full inhibitor, with an IC50 of 72.3 μM. Ajmalicine also can be used as anti-hypertensive, and serpentine, with sedative activity[1][2].
Quebrachidine
Origin: Plant; SubCategory_DNP: Alkaloids derived from tryptophan, Secologanin typtamine alkaloids, Indole alkaloids
3-[(E)-3,4-dihydroxy-3,5-dimethylhept-1-enyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one_major
Vincarine
D000970 - Antineoplastic Agents > D014748 - Vinca Alkaloids
(+)-Quebrachidine
3-[(1E)-3,4-Dihydroxy-3,5-dimethyl-1-hepten-1-yl]-7,8-dihydroxy-7-methyl-1,7,8,8a-tetrahydro-6H-isochromen-6-one
1-BENZYL-3-(4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)UREA
(2-TERT-BUTOXYCARBONYLAMINO-PYRIDIN-4-YL)-ACETICACID
CYCLOHEXANONE, 4-[[(1,1-DIMETHYLETHYL)DIPHENYLSILYL]OXY]-
Aluminum,bis(2-butanolato)(triethyl orthosilicato-kO)-
ETHYL 3-((7-ETHOXY-7-OXOHEPTYL)OXY)-4-METHOXYBENZOATE
Ethyl 2-(4-(tert-butoxycarbonyl)piperazin-1-yl)-4-hydroxypyrimidine-5-carboxylate
Valomaciclovir
C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
N-[1-(2,6-Dimethoxybenzyl)piperidin-4-Yl]-4-Sulfanylbutanamide
methyl (3S)-3-(3-carbamimidoylphenyl)-5-(4-carbamimidoylphenyl)pentanoate
[4]-Gingerdiol 3,5-diacetate
[4]-gingerdiol 3,5-diacetate is a member of the class of compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. [4]-gingerdiol 3,5-diacetate is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). [4]-gingerdiol 3,5-diacetate can be found in herbs and spices, which makes [4]-gingerdiol 3,5-diacetate a potential biomarker for the consumption of this food product. [4]-Gingerdiol 3,5-diacetate is found in herbs and spices. [4]-Gingerdiol 3,5-diacetate is a constituent of ginger (Zingiber officinale).
3-(3,4-Dihydroxy-3,5-dimethylhept-1-enyl)-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one
[(9R,10S,12S,13E,14R,16S,18R)-13-ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] acetate
(1R,4Z,6R,7R)-4-ethylidene-7,14-dihydroxy-6,7-dimethyl-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
[(10S,12R,13R,14S,16S,18R)-13-(hydroxymethyl)-14-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
Methyl (15S,16S,20S)-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,18-pentaene-19-carboxylate
D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
(16Z,19Z)-16,17,19,20-Tetradehydro-17-hydroxycorynan-16-carboxylic acid methyl ester
N-(1,3-benzodioxol-5-yl)-2-(3-methyl-1-piperidinyl)-2-phenylacetamide
4-(3,5-dimethyl-1-piperidinyl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide
2-(4-methylphenoxy)-N-[2-[oxo(1-piperidinyl)methyl]phenyl]acetamide
methyl (1R,9R,12S,13E,16S,18S)-13-ethylidene-18-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-17-carboxylate
Methyl (Z)-2-[(3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxyprop-2-enoate
methyl (1R,12S,19R)-12-[(1R)-1-hydroxyethyl]-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,9,13-pentaene-10-carboxylate
6-deoxy-2-O-(6-deoxy-2,3-di-O-methyl-alpha-L-mannopyranosyl)-3-O-methyl-alpha-L-mannopyranose
3-O-(2,3,4-tri-O-methyl-alpha-L-fucopyranosyl)-alpha-L-rhamnopyranose
isopseudostrychnine
A monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from the seeds of Strychnos nux-vomica.
N-[(2S,3R,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]propanamide
N-[(2S,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]propanamide
N-[2-(3,4-diethoxyphenyl)ethyl]-1H-indole-5-carboxamide
N-[(2S,3R,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]propanamide
N-[(2R,3S,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]propanamide
N-[(2R,3R,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]propanamide
1-[(1S,2aR,8bR)-1-(hydroxymethyl)-2-(phenylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone
N-[(2R,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]propanamide
N-[(2R,3R,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]propanamide
1-[(1R,2aR,8bR)-1-(hydroxymethyl)-2-(phenylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone
1-[(1R,2aS,8bS)-1-(hydroxymethyl)-2-(phenylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone
1-[(1S,2aS,8bS)-1-(hydroxymethyl)-2-(phenylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone
methyl (10S,13E,18S)-13-ethylidene-18-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-17-carboxylate
N-[(9S,13S,14S)-16-hydroxyimino-13-methyl-3-prop-2-enoxy-6,9,11,12,14,15-hexahydrocyclopenta[a]phenanthren-17-ylidene]hydroxylamine
methyl (1S,12S,13R,14R,15E)-15-ethylidene-13-(hydroxymethyl)-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate
methyl (1S,11R,13R,14S)-13-ethyl-13-hydroxy-8,15-diazahexacyclo[9.6.2.01,9.02,7.011,14.015,18]nonadeca-2,4,6,9-tetraene-10-carboxylate
(1S,8R,16S,17R)-11,12-dimethoxy-5,15-diazahexacyclo[13.4.2.01,16.05,16.08,17.09,14]henicosa-2,9,11,13-tetraen-21-one
methyl (12S,14S,15E)-15-ethylidene-13-(hydroxymethyl)-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate
methyl (15E)-15-ethylidene-13-(hydroxymethyl)-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate
methyl (1R,10S,12S,13E,16S,18R)-13-ethylidene-18-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-17-carboxylate
methyl (1S,5R,6R,8R,9S,10S)-8-ethyl-8-hydroxy-4,13-diazahexacyclo[10.7.0.01,5.04,9.06,10.014,19]nonadeca-11,14,16,18-tetraene-11-carboxylate
clidinium
C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics
Methyl (1R,12S,20R)-12-ethyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate
alpha-L-Rhap2,3Me2-(1->2)-alpha-L-Rhap3Me
A disaccharide derivative consisting of 3-O-methyl-alpha-L-rhamnose having a 2,3-di-O-methyl-alpha-L-rhamnosyl residue attached at the 2-position.
(19E)-geissoschizine
An indole alkaloid with formula C21H24N2O3. It is a biosynthetic precursor for a variety of monoterpenoid indole alkaloids.
2,3,4-tri-O-methyl-alpha-L-fucosyl-(1->3)-alpha-L-rhamnose
A glycosylrhamnose derivative consisting of alpha-L-rhamnose having a 2,3,4-tri-O-methyl-alpha-L-fucosyl residue attached at the 3-position.
(2r)-2-hydroxy-2-(2-hydroxy-4-methylphenyl)-3-[(2-methylpropanoyl)oxy]propyl (2r)-2-methylbutanoate
methyl 10-hydroxy-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate
8a,9a-dihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl 2-methylpropanoate
(2e)-n-(4-{[1-hydroxy-2-(4-hydroxyphenyl)ethylidene]amino}butyl)-3-phenylprop-2-enimidic acid
(3as,5ar,6r,8r,9s,9as,9bs)-6,9-dihydroxy-5a,9-dimethyl-3-methylidene-2-oxo-octahydronaphtho[1,2-b]furan-8-yl 2-methylpropanoate
(1r,9s,10s,11r,12e,17s)-8-acetyl-12-ethylidene-6-hydroxy-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6-triene-10-carbaldehyde
methyl (1s,18r,19r,20r)-18-hydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8,15-pentaene-19-carboxylate
methyl (1s,12s,13s,14s,15z)-15-ethylidene-13-(hydroxymethyl)-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate
methyl (1s,15s,16r,18s)-16-ethyl-12-oxo-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
(1r,10s,12s,13r,14s,16s,17s,18r)-13-(hydroxymethyl)-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-18-yl acetate
methyl (1r,12r,16s,22r)-15-oxa-8,19-diazahexacyclo[10.9.1.0¹,⁹.0²,⁷.0¹²,¹⁶.0¹⁹,²²]docosa-2,4,6,9-tetraene-10-carboxylate
(7s,8s,8as)-3-[(1e,3s,4s,5r)-3,4-dihydroxy-3,5-dimethylhept-1-en-1-yl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1h-isochromen-6-one
methyl (1r,9s,10r,12r,19s,20s)-10-hydroxy-20-methyl-8,16-diazahexacyclo[10.6.1.1⁹,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,13-tetraene-10-carboxylate
(1s,14as,15r,16r,17ar)-16-chloro-1-ethyl-15-hydroxy-1h,4h,5h,6h,9h,12h,14ah,15h,16h,17h,17ah-cyclopenta[c]oxacyclohexadecan-3-one
methyl (1r,10s,12r,13e,18r)-13-ethylidene-6-methoxy-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
methyl 13-ethylidene-18-hydroxy-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6-triene-17-carboxylate
(1r,10s,13r,14s,16s)-13-(hydroxymethyl)-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-18-yl acetate
(1s,8r,16s)-11,12-dimethoxy-5,15-diazahexacyclo[13.4.2.0¹,¹⁶.0⁵,¹⁶.0⁸,¹⁷.0⁹,¹⁴]henicosa-2,9(14),10,12-tetraen-21-one
methyl (1s,15r,17s,18s)-17-ethyl-11-oxo-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
(3r,5s)-5-(acetyloxy)-1-(4-hydroxy-3-methoxyphenyl)octan-3-yl acetate
methyl (1r,9r,16s,18s,20s,21r)-20-hydroxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-18-carboxylate
(2e)-4-[(1r,5r,6r)-3-heptyl-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methylbut-2-enoic acid
methyl (13e,14s,16s,18r)-13-ethylidene-18-(hydroxymethyl)-1,11-diazapentacyclo[12.3.1.0²,⁷.0⁸,¹⁷.0¹¹,¹⁶]octadeca-2,4,6,8(17)-tetraene-18-carboxylate
1-[(1r,11s,12e,17s)-12-ethylidene-10-(hydroxymethyl)-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,9-tetraen-8-yl]-2-hydroxyethanone
methyl (13e)-13-ethylidene-6-methoxy-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
1-{6-methoxy-20-methyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-17-yl}ethanone
methyl (1s,15r,17s,18s)-17-ethyl-14-oxo-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
(2s,3r,4s,5r)-2-[4-hydroxy-2-isopropyl-5-(3-methylbut-2-en-1-yl)phenoxy]oxane-3,4,5-triol
[(1s,14r)-15-formyl-16-methyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraen-13-yl]methyl acetate
(1r,11r,12r,13r,14e,19s,21s)-11-hydroxy-14-(2-hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6-trien-9-one
(1'r,2's,3s,5's,6's,8'r,11's)-2'-ethenyl-1-methoxy-4'-methyl-9'-oxa-4'-azaspiro[indole-3,7'-tetracyclo[6.3.1.0²,⁶.0⁵,¹¹]dodecan]-2-one
(1r,2z,4r,8r,9r,11r,12r)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-9-(2-methylpropoxy)-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-6-one
(3ar,4r,6s,9s,11ar)-6,9-dihydroxy-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,7h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylpropanoate
methyl (1s,5r,6r,8r)-8-ethyl-8-hydroxy-4,13-diazahexacyclo[10.7.0.0¹,⁵.0⁴,⁹.0⁶,¹⁰.0¹⁴,¹⁹]nonadeca-11,14,16,18-tetraene-11-carboxylate
11-hydroxy-14-(2-hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6-trien-9-one
(19e)-19-ethylidene-18-methoxy-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraen-14-one
methyl (15r,17r,19s)-15-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.0²,⁷.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-2,4,6,8(18),13-pentaene-17-carboxylate
methyl (1r,14r,15e)-15-ethylidene-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.0³,¹¹.0⁴,⁹]octadeca-3(11),4,6,8-tetraene-18-carboxylate
methyl (1s,12s,13s,14s,15e)-15-ethylidene-13-(hydroxymethyl)-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate
6,9a-dihydroxy-3,5a-dimethyl-9-methylidene-2-oxo-octahydronaphtho[1,2-b]furan-4-yl 2-methylpropanoate
methyl (13e)-13-ethylidene-18-(hydroxymethyl)-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
1-(4-hydroxy-3-methoxyphenyl)-3,5-diacetoxy-octane
{"Ingredient_id": "HBIN001477","Ingredient_name": "1-(4-hydroxy-3-methoxyphenyl)-3,5-diacetoxy-octane","Alias": "NA","Ingredient_formula": "C19H28O6","Ingredient_Smile": "CCCC(CC(CCC1=CC(=C(C=C1)O)OC)OC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15879","TCMID_id": "10435","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-Ep-i19-S-vindolinine-N-oxide
{"Ingredient_id": "HBIN001891","Ingredient_name": "16-Ep-i19-S-vindolinine-N-oxide","Alias": "NA","Ingredient_formula": "C21H24N2O3","Ingredient_Smile": "CC1C23CC(C14C5(C2[N+](CC5)(CC=C3)[O-])C6=CC=CC=C6N4)C(=O)OC","Ingredient_weight": "352.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34375","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "78358538","DrugBank_id": "NA"}
16-epideacetylakuammiline
{"Ingredient_id": "HBIN001892","Ingredient_name": "16-epideacetylakuammiline","Alias": "NA","Ingredient_formula": "C21H24N2O3","Ingredient_Smile": "CC=C1CN2CCC34C5=CC=CC=C5N=C3C2CC1C4(CO)C(=O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6877","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-hydroxymethylpleiocarpamine
{"Ingredient_id": "HBIN001917","Ingredient_name": "16-hydroxymethylpleiocarpamine","Alias": "NA","Ingredient_formula": "C21H24N2O3","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10516","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
19-(z)-akuammidine
{"Ingredient_id": "HBIN002224","Ingredient_name": "19-(z)-akuammidine","Alias": "NA","Ingredient_formula": "C21H24N2O3","Ingredient_Smile": "CC=C1CN2C3CC1C(C2CC4=C3NC5=CC=CC=C45)(CO)C(=O)OC","Ingredient_weight": "352.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "824","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44583830","DrugBank_id": "NA"}
(2s)-2-[(3ar*,4s*,7r*,7as*)-3a,7a-dimethyl-1,3-dioxo-4,7-epoxy-octahydroisoindol-2-yl]-5-guanidino pentanoicacid
{"Ingredient_id": "HBIN006579","Ingredient_name": "(2s)-2-[(3ar*,4s*,7r*,7as*)-3a,7a-dimethyl-1,3-dioxo-4,7-epoxy-octahydroisoindol-2-yl]-5-guanidino pentanoicacid","Alias": "NA","Ingredient_formula": "C16H24N4O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6340","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
Ⅳ,ajmalicine
{"Ingredient_id": "HBIN014954","Ingredient_name": "\u2163,ajmalicine","Alias": "NA","Ingredient_formula": "C21H24N2O3","Ingredient_Smile": "CC1C2CN3CCC4=C(C3CC2C(=CO1)C(=O)OC)NC5=CC=CC=C45","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40763","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
akuammidine
{"Ingredient_id": "HBIN015025","Ingredient_name": "akuammidine","Alias": "NA","Ingredient_formula": "C21H24N2O3","Ingredient_Smile": "CC=C1CN2C3CC1C(C2CC4=C3NC5=CC=CC=C45)(CO)C(=O)OC","Ingredient_weight": "352.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32835","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "138113962","DrugBank_id": "NA"}